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pyridin-3-ylmethyl-(pyridin-4-ylmethyl)-[[3-(trifluoromethyl)phenyl]methyl]azanium

pyridin-3-ylmethyl-(pyridin-4-ylmethyl)-[[3-(trifluoromethyl)phenyl]methyl]azanium

Systemtic Name:pyridin-3-ylmethyl-(pyridin-4-ylmethyl)-[[3-(trifluoromethyl)phenyl]methyl]azanium
Openeye Name:3-pyridylmethyl-(4-pyridylmethyl)-[[3-(trifluoromethyl)phenyl]methyl]ammonium
CAS Name:3-pyridinylmethyl-(pyridin-4-ylmethyl)-[[3-(trifluoromethyl)phenyl]methyl]ammonium
IUPAC Name:pyridin-3-ylmethyl-(pyridin-4-ylmethyl)-[[3-(trifluoromethyl)phenyl]methyl]azanium
Traditional Name:3-pyridylmethyl-(4-pyridylmethyl)-[3-(trifluoromethyl)benzyl]ammonium
Formula: C20H19F3N3+
MolecularWeight: 358.38017
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C[NH+](CC2=CC=NC=C2)CC3=CN=CC=C3


Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C[NH+](CC2=CC=NC=C2)CC3=CN=CC=C3


InChI

InChI=1S/C20H18F3N3/c21-20(22,23)19-5-1-3-17(11-19)14-26(13-16-6-9-24-10-7-16)15-18-4-2-8-25-12-18/h1-12H,13-15H2/p+1


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